Vitas-M small molecule compound

ethyl 2-[(cyclohexylcarbonyl)amino]-5-[(2,5-dimethylphenyl)carbamoyl]-4-methylthiophene-3-carboxylate

Catalog ID
STK003918
SMILES CCOC(=O)c1c(NC(=O)C2CCCCC2)sc(c1C)C(=O)Nc1cc(C)ccc1C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C24H30N2O4S MW 442.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N2O4S/c1-5-30-24(29)19-16(4)20(22(28)25-18-13-14(2)11-12-15(18)3)31-23(19)26-21(27)17-9-7-6-8-10-17/h11-13,17H,5-10H2,1-4H3,(H,25,28)(H,26,27)
InChIKey
CBBBJPUYQZRWLZ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=C(C=CC(=C2)C)C)NC(=O)C3CCCCC3
CCOC(=O)c1c(NC(=O)C2CCCCC2)sc(c1C)C(=O)Nc1cc(C)ccc1C
ETHYL2((CYCLOHEXYLCARBONYL)AMINO)5((25DIMETHYLPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2(CYCLOHEXANECARBONYLAMINO)5((25DIMETHYLPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL5(N(25DIMETHYLPHENYL)CARBAMOYL)2(CYCLOHEXYLCARBONYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC24H30N2O4Sc153024(29)1916(4)20(22(28)25181314(2)111215(18)3)3123(19)2621(27)1797681017h111317H510H214H3(H2528)(H2627)
MFCD02627388
STK003918
ZINC000000863369
ZINC00863369
ZINC863369

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.